About N,6-diphenylquinazolin-4-amine
N,6-diphenylquinazolin-4-amine (PubChem CID 86766666) has the molecular formula C20H15N3
and a molecular weight of 297.36 g/mol. Its IUPAC name is N,6-diphenylquinazolin-4-amine.
Molecular Properties
| Compound Name | N,6-diphenylquinazolin-4-amine |
| PubChem CID | 86766666 |
| Molecular Formula | C20H15N3 |
| Molecular Weight | 297.36 g/mol |
| Exact Mass | 297.13 |
| IUPAC Name | N,6-diphenylquinazolin-4-amine |
| SMILES | c1ccc(Nc2ncnc3ccc(-c4ccccc4)cc23)cc1 |
| InChI | InChI=1S/C20H15N3/c1-3-7-15(8-4-1)16-11-12-19-18(13-16)20(22-14-21-19)23-17-9-5-2-6-10-17/h1-14H,(H,21,22,23) |
| InChIKey | YSXBBNUOGPSKGB-UHFFFAOYSA-N |
| XLogP | 5.04 |
| TPSA | 37.81 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 297.36 |
| LogP ≤ 5 | 5.04 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N,6-diphenylquinazolin-4-amine?
The IUPAC name of N,6-diphenylquinazolin-4-amine (CID 86766666) is N,6-diphenylquinazolin-4-amine.
What is the SMILES notation for N,6-diphenylquinazolin-4-amine?
The canonical SMILES for N,6-diphenylquinazolin-4-amine is c1ccc(Nc2ncnc3ccc(-c4ccccc4)cc23)cc1.
What is the InChIKey of N,6-diphenylquinazolin-4-amine?
The InChIKey is YSXBBNUOGPSKGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N3/c1-3-7-15(8-4-1)16-11-12-19-18(13-16)20(22-14-21-19)23-17-9-5-2-6-10-17/h1-14H,(H,21,22,23).
What are the key properties of N,6-diphenylquinazolin-4-amine?
N,6-diphenylquinazolin-4-amine has a molecular weight of 297.36 g/mol, XLogP of 5.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-diphenylquinazolin-4-amine is sourced from PubChem (CID 86766666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).